%chk=000180971.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180971

0 1
Cl 6.017200 -1.331493 -0.922396
S -0.616893 -0.570402 1.261968
O -0.108425 -1.919634 1.112205
O -3.334529 1.580632 -0.360205
O 0.951847 2.801223 0.123635
N -1.938201 -0.202276 0.182420
N 0.589877 0.548879 0.595583
N -1.230445 2.101331 0.401012
C -2.803506 -1.225654 -0.544038
C -4.224663 -1.218365 0.078431
C -2.171846 -2.616458 -0.454050
C -2.887387 -0.814336 -2.026446
C -2.257781 1.162776 0.021671
C -4.279297 -1.619996 1.547038
C 0.188449 1.882101 0.331779
C 1.912991 0.109968 0.225514
C -1.655432 3.530088 0.501596
C 2.542982 0.629371 -0.923048
C 2.564324 -0.850415 1.022403
C 3.817034 0.186311 -1.276021
C 3.836125 -1.299437 0.661286
C 4.445129 -0.776354 -0.481227
H -4.867685 -1.896162 -0.517105
H -4.670507 -0.204970 -0.043674
H -2.770957 -3.344072 -1.016447
H -2.105545 -3.000809 0.572434
H -1.156745 -2.654416 -0.873069
H -3.429774 -1.562552 -2.614532
H -1.895171 -0.707463 -2.477621
H -3.416882 0.140221 -2.162594
H -5.318005 -1.653082 1.899906
H -3.747685 -0.904664 2.183755
H -3.845994 -2.612148 1.719538
H -1.819829 3.787817 1.560092
H -2.594669 3.700774 -0.057656
H -0.880173 4.201339 0.086811
H 2.052035 1.396080 -1.525774
H 2.089539 -1.264384 1.912491
H 4.315516 0.587566 -2.159461
H 4.346279 -2.049335 1.267395


%chk=000180971-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180971

0 1
Cl 5.624650 -1.873089 -1.283441
S -0.757077 -0.388280 1.631161
O -0.063351 -1.846576 1.632931
O -3.274707 1.678963 -0.500084
O 0.871934 3.020833 0.238373
N -1.862842 -0.114467 0.080867
N 0.659455 0.784987 0.900113
N -1.284146 2.145847 0.663584
C -2.633837 -1.182911 -0.673994
C -4.095755 -1.288111 -0.130483
C -1.901984 -2.543795 -0.565479
C -2.648658 -0.767608 -2.172386
C -2.217549 1.236559 0.034319
C -4.225006 -1.558232 1.381978
C 0.152540 2.033555 0.551504
C 1.835000 0.189048 0.383278
C -1.780078 3.541261 0.813094
C 2.181376 0.331922 -0.990272
C 2.650772 -0.598956 1.238056
C 3.343803 -0.279055 -1.494212
C 3.800634 -1.238029 0.730378
C 4.132492 -1.065161 -0.626812
H -4.583424 -2.107995 -0.694616
H -4.625443 -0.353513 -0.384973
H -2.422270 -3.253432 -1.232472
H -1.904575 -2.965342 0.450891
H -0.851593 -2.466695 -0.893257
H -3.183249 -1.546055 -2.746760
H -1.618209 -0.697162 -2.563826
H -3.162493 0.194033 -2.323024
H -5.290401 -1.630418 1.665709
H -3.788714 -0.734571 1.978640
H -3.737796 -2.502367 1.686170
H -1.149301 4.057952 1.551509
H -2.825129 3.505975 1.152957
H -1.733657 4.087903 -0.143637
H 1.559775 0.948553 -1.646452
H 2.389887 -0.704225 2.294232
H 3.630485 -0.153646 -2.542049
H 4.429742 -1.850101 1.382083


